10fthf	C20H21N7O7	-144.281	9.25815	-2
12dgr120	C27H52O5	-157.886	5.41749	0
12dgr140	C31H60O5	-151.305	6.19359	0
12dgr141	C31H56O5	-106.622	6.09129	0
12dgr160	C35H68O5	-144.723	6.99099	0
12dgr161	C35H64O5	-100.041	6.79083	0
12dgr180	C39H76O5	-138.142	7.80318	0
12dgr181	C39H72O5	-93.4598	7.5252	0
12ppd_R	C3H8O2	-79.6929	0.881352	0
12ppd_S	C3H8O2	-79.6929	0.881352	0
13dpg	C3H6O10P2	-585.811	1.012227	-2
14glucan	C36H62O31	-1006.5	25.51038	0
15dap	C5H16N2	-4.4171	1.540344	2
1agpe120	C17H36NO7P	-331.897	3.60048	0
1agpe140	C19H40NO7P	-328.606	3.97236	0
1agpe141	C19H38NO7P	-307.108	3.94173	0
1agpe160	C21H44NO7P	-325.316	4.35561	0
1agpe161	C21H42NO7P	-302.974	4.2093	0
1agpe180	C23H48NO7P	-322.025	4.74744	0
1agpe181	C23H46NO7P	-299.684	4.57272	0
1agpg120	C18H36O9P	-403.311	3.75744	-1
1agpg140	C20H40O9P	-400.02	4.11516	-1
1agpg141	C20H38O9P	-378.522	4.08558	-1
1agpg160	C22H44O9P	-396.73	4.4862	-1
1agpg161	C22H42O9P	-374.388	4.34433	-1
1agpg180	C24H48O9P	-393.439	4.86756	-1
1agpg181	C24H46O9P	-371.098	4.69731	-1
1ddecg3p	C15H30O7P	-348.775	2.97186	-1
1hdec9eg3p	C19H36O7P	-319.853	3.63474	-1
1hdecg3p	C19H38O7P	-342.194	3.75348	-1
1odec11eg3p	C21H40O7P	-316.562	4.00341	-1
1odecg3p	C21H42O7P	-338.904	4.15695	-1
1pyr5c	C5H6NO2	-60.2665	2.403678	-1
1tdec7eg3p	C17H32O7P	-323.144	3.28185	-1
1tdecg3p	C17H34O7P	-345.485	3.35748	-1
23camp	C10H11N5O6P	-193.641	10.9185	-1
23ccmp	C9H11N3O7P	-281.075	8.56782	-1
23cgmp	C10H11N5O7P	-243.35	10.26975	-1
23cump	C9H10N2O8P	-332.927	8.49648	-1
23dappa	C3H9N2O2	-89.0161	1.231197	1
23ddhb	C7H7O4	-126.785	3.19287	-1
23dhb	C7H5O4	-131.625	3.18027	-1
23dhba	C17H17N5O10P	-335.813	9.37719	-1
23dhbzs	C10H10NO6	-198.725	3.79446	-1
23dhdp	C7H5NO4	-134.601	3.85617	-2
23dhmb	C5H9O4	-160.787	1.356606	-1
23dhmp	C6H11O4	-159.142	1.373796	-1
23doguln	C6H7O7	-247.176	2.030307	-1
25aics	C13H16N4O12P	-486.886	5.54529	-3
25dkglcn	C6H7O7	-249.667	1.802874	-1
25drapp	C9H15N5O8P	-326.157	7.02618	-1
26dap_LL	C7H14N2O4	-163.743	1.643229	0
26dap_M	C7H14N2O4	-163.743	1.643229	0
2agpe120	C17H36NO7P	-331.897	3.60048	0
2agpe140	C19H40NO7P	-328.606	3.97236	0
2agpe141	C19H38NO7P	-306.265	3.86034	0
2agpe160	C21H44NO7P	-325.316	4.35561	0
2agpe161	C21H42NO7P	-302.974	4.2093	0
2agpe180	C23H48NO7P	-322.025	4.74744	0
2agpe181	C23H46NO7P	-299.684	4.57272	0
2agpg120	C18H36O9P	-403.311	3.75744	-1
2agpg140	C20H40O9P	-400.02	4.11516	-1
2agpg141	C20H38O9P	-377.679	4.00713	-1
2agpg160	C22H44O9P	-396.73	4.4862	-1
2agpg161	C22H42O9P	-374.388	4.34433	-1
2agpg180	C24H48O9P	-393.439	4.86756	-1
2agpg181	C24H46O9P	-371.098	4.69731	-1
2ahbut	C6H9O4	-151.149	1.277751	-1
2amsa	C3H5NO3	-114.702	0.896313	0
2aobut	C4H7NO3	-116.248	0.964332	0
2cpr5p	C12H14NO9P	-391.587	3.25965	-2
2dda7p	C7H11O10P	-467.906	1.917243	-2
2ddecg3p	C15H30O7P	-348.775	2.97186	-1
2ddg6p	C6H9O9P	-431.607	1.485657	-2
2ddglcn	C6H9O6	-222.206	1.514988	-1
2dh3dgal	C6H9O6	-219.715	1.608039	-1
2dh3dgal6p	C6H9O9P	-431.607	1.485657	-2
2dhglcn	C6H9O7	-257.66	2.03544	-1
2dhguln	C6H9O7	-257.66	2.03544	-1
2dhp	C6H9O4	-148.659	1.386813	-1
2dmmq8	C50H70O2	208.472	12.5226	0
2dmmql8	C50H72O2	184.069	13.08057	0
2dr1p	C5H10O7P	-352.902	3.33513	-1
2dr5p	C5H10O7P	-352.903	3.33513	-1
2h3oppan	C3H3O4	-149.817	0.786288	-1
2hdec9eg3p	C19H36O7P	-319.853	3.63474	-1
2hdecg3p	C19H38O7P	-342.194	3.75348	-1
2ippm	C7H8O4	-142.678	2.153916	-2
2kmb	C5H7O3S	-100.378	2.256924	-1
2mahmp	C6H9N3O7P2	-412.404	4.88511	-2
2mcacn	C7H5O6	-222.612	2.844453	-3
2mcit	C7H7O7	-280.414	1.411347	-3
2me4p	C5H12O7P	-365.504	1.558785	-1
2obut	C4H5O3	-110.928	0.888039	-1
2odec11eg3p	C21H40O7P	-316.562	4.00341	-1
2odecg3p	C21H42O7P	-338.904	4.15695	-1
2ohph	C46H70O2	175.255	11.89902	0
2ombzl	C47H72O3	150.787	12.23622	0
2omhmbl	C48H74O4	109.789	12.97902	0
2ommbl	C48H74O3	149.205	12.60006	0
2omph	C47H72O2	190.202	12.0123	0
2oph	C46H70O	214.671	11.75475	0
2p4c2me	C14H23N3O17P3	-856.975	5.85144	-3
2pg	C3H5O7P	-371.137	0.791289	-2
2pglyc	C2H3O6P	-334.839	0.576549	-2
2shchc	C11H10O6	-193.519	3.25242	-2
2tdec7eg3p	C17H32O7P	-323.144	3.28185	-1
2tdecg3p	C17H34O7P	-345.485	3.35748	-1
2tpr3dpcoa	C26H41N7O26P5S	-1297.08	11.82822	-5
34dhpac	C8H8O3	-75.6652	3.13326	0
34hpp	C9H7O4	-114.858	2.611563	-1
3amp	C10H13N5O7P	-257.26	8.69277	-1
3c2hmp	C7H10O5	-199.539	1.567311	-2
3c3hmp	C7H10O5	-199.539	1.567311	-2
3c4mop	C7H8O5	-189.056	1.416216	-2
3cmp	C9H13N3O8P	-344.694	5.45511	-1
3dhguln	C6H9O7	-260.15	1.962759	-1
3dhgulnp	C6H9O10P	-472.042	1.801227	-2
3dhq	C7H9O6	-215.063	2.601939	-1
3dhsk	C7H7O5	-166.834	2.621781	-1
3gmp	C10H13N5O8P	-306.969	7.86246	-1
3hbcoa	C25H39N7O18P3S	-819.292	10.18368	-3
3hcinnm	C9H7O3	-71.3229	3.189	-1
3hdcoa	C31H51N7O18P3S	-809.421	10.45653	-3
3hddcoa	C33H55N7O18P3S	-806.13	10.58148	-3
3hhcoa	C27H43N7O18P3S	-816.002	10.25715	-3
3hhdcoa	C37H63N7O18P3S	-799.549	10.87893	-3
3hocoa	C29H47N7O18P3S	-812.711	10.34826	-3
3hodcoa	C39H67N7O18P3S	-796.258	11.05014	-3
3hpppn	C9H9O3	-87.3972	2.530218	-1
3htdcoa	C35H59N7O18P3S	-802.839	10.72248	-3
3ig3p	C11H13NO6P	-267.266	4.34304	-1
3mob	C5H7O3	-111.038	1.09398	-1
3mop	C6H9O3	-109.393	1.115223	-1
3odcoa	C31H49N7O18P3S	-801.428	10.49322	-3
3oddcoa	C33H53N7O18P3S	-798.137	10.61775	-3
3ohcoa	C27H41N7O18P3S	-808.009	10.29453	-3
3ohdcoa	C37H61N7O18P3S	-791.556	10.91418	-3
3oocoa	C29H45N7O18P3S	-804.718	10.38534	-3
3oodcoa	C39H65N7O18P3S	-788.265	11.08488	-3
3ophb	C47H69O3	132.015	11.90883	-1
3otdcoa	C35H57N7O18P3S	-794.847	10.75827	-3
3pg	C3H5O7P	-371.138	0.791289	-2
3php	C3H3O7P	-360.654	0.944172	-2
3psme	C10H10O10P	-427.373	3.39693	-3
3ump	C9H12N2O9P	-396.546	5.34234	-1
4abut	C4H9NO2	-84.5415	0.901572	0
4abutn	C4H10NO	-31.7484	0.977838	1
4abz	C7H6NO2	-48.7498	2.742933	-1
4adcho	C10H10NO5	-135.145	3.89736	-1
4ahmmp	C6H9N3O	7.6106	4.86372	0
4ampm	C6H9N3O4P	-204.281	4.87194	-1
4c2me	C14H23N3O14P2	-645.083	5.92257	-2
4h2opntn	C5H7O4	-147.227	1.040355	-1
4hba	C7H8O2	-47.3237	2.552391	0
4hbz	C7H5O3	-92.2091	2.588682	-1
4hoxpacd	C8H8O2	-36.2494	2.530719	0
4hthr	C4H9NO4	-160.43	1.26975	0
4mhetz	C6H9NOS	-5.3921	3.43131	0
4mop	C6H9O3	-109.393	1.115223	-1
4mpetz	C6H9NO4PS	-217.284	3.44298	-1
4pasp	C4H7NO7P	-380.523	1.051401	-1
4per	C4H7O8P	-407.437	1.227729	-2
4ppan	C9H16NO8P	-400.189	2.36598	-2
4ppcys	C12H21N2O9PS	-426.495	4.44816	-2
4r5au	C9H16N4O6	-189.15	5.31759	0
5aizc	C9H13N3O9P	-374.068	5.97951	-1
5aop	C5H9NO3	-112.848	1.039851	0
5aprbu	C9H16N4O9P	-401.042	5.26011	-1
5apru	C9H14N4O9P	-393.514	6.15291	-1
5caiz	C9H13N3O9P	-374.068	5.97951	-1
5dglcn	C6H9O7	-260.15	1.962759	-1
5dh4dglc	C6H6O7	-263.079	1.463994	-2
5drib	C5H10O4	-144.764	3.69318	0
5mdr1p	C6H12O7PS	-346.105	4.17999	-1
5mdru1p	C6H12O7PS	-345.64	2.466234	-1
5mta	C11H15N5O3S	1.3706	8.92332	0
5mthf	C20H23N7O6	-101.36	8.2206	-2
5mtr	C6H12O4S	-134.214	4.22502	0
5prdmbz	C14H18N2O7P	-289.316	5.90847	-1
6hmhpt	C7H9N5O2	-3.0388	7.4184	0
6hmhptpp	C7H9N5O8P2	-423.053	7.43247	-2
6pgc	C6H11O10P	-480.035	2.243223	-2
6pgl	C6H10O9P	-427.464	3.51117	-1
8aonn	C9H17NO3	-108.022	1.450278	0
aacald	C2H6NO	-35.039	0.762027	1
aacoa	C25H37N7O18P3S	-811.3	10.22133	-3
aact	C3H8NO	-36.585	0.840978	1
ac	C2H3O2	-88.29	1.5	-1
acac	C4H5O3	-113.419	0.705702	-1
acald	C2H4O	-33.4	1.5	0
acanth	C9H8NO3	-86.8211	3.18792	-1
accoa	C23H35N7O17P3S	-784.639	10.09884	-3
acetol	C3H6O2	-71.7	0.722577	0
acg5p	C7H10NO8P	-408.605	2.126673	-2
acg5sa	C7H10NO4	-141.139	2.065815	-1
acgal	C8H15NO6	-212.351	4.61613	0
acgal1p	C8H15NO9P	-424.242	4.5498	-1
acgam	C8H15NO6	-212.351	4.61613	0
acgam1p	C8H15NO9P	-424.242	4.5498	-1
acgam6p	C8H15NO9P	-424.242	4.5498	-1
acglc_D	C8H14O7	-255.193	4.39512	0
acglu	C7H9NO5	-193.932	2.074959	-2
acmalt	C14H24O12	-412.945	8.49105	0
acmana	C8H15NO6	-212.351	4.61613	0
acmanap	C8H15NO9P	-424.242	4.5498	-1
acmum	C11H18NO8	-275.421	4.72815	-1
acmum6p	C11H18NO11P	-487.312	4.68795	-2
acnam	C11H18NO9	-325.933	4.37607	-1
acolipa	C181H317N3O103P4	-3715.56	63.3255	-6
acon_C	C6H3O6	-222.121	2.142924	-3
acon_T	C6H3O6	-222.121	2.142924	-3
aconm	C7H6O6	-217.857	2.392458	-2
acorn	C7H14N2O3	-115.453	2.137326	0
acser	C5H9NO4	-161.586	1.483605	0
actp	C2H4O5P	-301.431	0.762291	-1
ade	C5H5N5	77.9637	7.84347	0
adn	C10H13N5O4	-45.3684	8.71452	0
adp	C10H13N5O10P2	-465.383	8.70018	-2
adpglc	C16H23N5O15P2	-621.775	11.16873	-2
adphep_DD	C17H25N5O16P2	-658.074	11.24325	-2
adphep_LD	C17H25N5O16P2	-658.074	11.24325	-2
adprib	C15H21N5O14P2	-584.989	10.82493	-2
agm	C5H16N4	6.6269	4.46985	2
ahcys	C14H20N6O5S	-76.076	8.97099	0
ahdt	C9H12N5O13P3	-694.275	7.53669	-4
aicar	C9H14N4O8P	-335.463	5.53773	-1
air	C8H13N3O7P	-296.924	4.947	-1
akg	C5H4O5	-188.836	1.053174	-2
ala_B	C3H7NO2	-86.1868	0.760365	0
ala_D	C3H7NO2	-87.942	0.813312	0
ala_L	C3H7NO2	-87.942	0.813312	0
alaala	C6H12N2O3	-118.853	2.226864	0
alac_S	C5H7O4	-152.795	1.259253	-1
all_D	C6H12O6	-217.738	4.33182	0
all6p	C6H12O9P	-429.63	4.23405	-1
alltn	C4H6N4O3	-116.179	5.69427	0
alltt	C4H7N4O4	-167.4	5.47653	-1
allul6p	C6H12O9P	-428.678	2.024232	-1
altrn	C6H11O7	-268.143	2.422695	-1
amet	C15H23N6O5S	-66.5126	10.64703	1
ametam	C14H24N6O3S	13.1505	10.64982	2
amob	C15H19N5O6S	-91.1441	10.65081	0
amp	C10H13N5O7P	-257.26	8.69277	-1
anhgm	C19H29N2O12	-375.778	8.60217	-1
anhgm3p	C34H52N6O19	-620.575	12.45972	-2
anhgm4p	C37H57N7O20	-651.486	14.01318	-2
anhm	C11H16NO7	-223.415	4.18515	-1
anhm3p	C26H39N5O14	-468.212	8.78658	-2
anhm4p	C29H44N6O15	-499.123	10.54398	-2
anth	C7H6NO2	-48.7498	2.742933	-1
ap4a	C20H24N10O19P4	-865.651	17.44191	-4
ap5a	C20H24N10O22P5	-1073.77	17.46768	-5
apg120	C42H80O11P	-445.315	8.42235	-1
apg140	C48H92O11P	-435.443	9.57993	-1
apg141	C48H86O11P	-368.419	9.40128	-1
apg160	C54H104O11P	-425.571	10.77003	-1
apg161	C54H98O11P	-358.547	10.45098	-1
apg180	C60H116O11P	-415.699	11.98296	-1
apg181	C60H110O11P	-348.676	11.55171	-1
aps	C10H12N5O10PS	-368.247	8.93598	-2
ara5p	C5H10O8P	-390.942	1.766151	-1
arab_L	C5H10O5	-179.442	3.85374	0
aragund	C71H115NO17P2	-463.976	18.22779	-2
arbt6p	C12H16O10P	-418.612	5.02398	-1
arbtn	C22H33N4O13	-448.15	8.98278	-3
arg_L	C6H15N4O2	-73.0362	4.46325	1
argsuc	C10H17N4O6	-224.46	5.21652	-1
ascb_L	C6H7O6	-193.752	4.40964	-1
ascb6p	C6H7O9P	-405.644	4.3665	-2
asn_L	C4H8N2O3	-123.245	1.680786	0
asp_L	C4H6NO4	-165.85	0.942426	-1
aspsa	C4H7NO3	-113.057	0.922122	0
athr_L	C4H9NO3	-124.241	1.145976	0
atp	C10H13N5O13P3	-673.506	8.72229	-3
b2coa	C25H37N7O17P3S	-760.528	10.21821	-3
bbtcoa	C28H47N8O17P3S	-725.725	11.79783	-2
betald	C5H12NO	21.6586	5.89296	1
bglycogen	C6H10O5	-167.2	16.98741	0
btal	C4H8O	-30.6743	0.716724	0
btcoa	C25H39N7O17P3S	-781.348	10.1637	-3
btn	C10H15N2O3S	-109.828	6.36099	-1
but	C4H7O2	-83.4674	0.608574	-1
butso3	C4H9O3S	-122.419	2.325426	-1
camp	C10H11N5O6P	-192.13	10.93929	-1
cbasp	C5H6N2O5	-204.219	2.83179	-2
cbp	CH2NO5P	-300.574	1.558611	-2
cdp	C9H13N3O11P2	-552.817	5.46687	-2
cdpdddecg	C36H63N3O15P2	-649.357	7.91058	-2
cdpdhdec9eg	C44H75N3O15P2	-591.512	8.92854	-2
cdpdhdecg	C44H79N3O15P2	-636.194	9.10239	-2
cdpdodec11eg	C48H83N3O15P2	-584.931	9.51882	-2
cdpdodecg	C48H87N3O15P2	-629.613	9.7593	-2
cdpdtdec7eg	C40H67N3O15P2	-598.093	8.38641	-2
cdpdtdecg	C40H71N3O15P2	-642.775	8.48319	-2
cechddd	C9H11O4	-121.973	3.14565	-1
cenchddd	C9H9O4	-105.899	4.0893	-1
cgly	C5H10N2O3S	-114.138	2.666709	0
chol	C5H14NO	12.2296	5.89479	1
chor	C10H8O6	-170.26	3.87351	-2
cinnm	C9H7O2	-31.9071	3.0006	-1
cit	C6H5O7	-280.304	1.364421	-3
citr_L	C6H13N3O3	-124.095	2.902164	0
ckdo	C17H24N3O15P	-578.37	8.31558	-2
clpn120	C57H108O17P2	-732.743	11.52129	-2
clpn140	C65H124O17P2	-719.581	13.04943	-2
clpn141	C65H116O17P2	-630.216	12.7968	-2
clpn160	C73H140O17P2	-706.419	14.62338	-2
clpn161	C73H132O17P2	-617.054	14.18826	-2
clpn180	C81H156O17P2	-693.256	16.22982	-2
clpn181	C81H148O17P2	-603.891	15.64806	-2
cmp	C9H13N3O8P	-344.694	5.45511	-1
co2	CO2	-92.26	1.5	0
coa	C21H33N7O16P3S	-750.868	9.84987	-3
colipa	C176H307N2O100P4	-3632.58	60.0012	-7
cpe160	C39H73NO8P	-265.18	12.13611	-1
cpe180	C43H81NO8P	-258.599	12.59163	-1
cpg160	C40H74O10P	-364.159	11.87157	-1
cpg180	C44H82O10P	-357.577	12.3369	-1
cpgn_un	C35H56N6O13	-339.153	13.80984	0
crn	C7H15NO3	-65.7882	5.91762	0
crn_D	C7H15NO3	-65.7882	5.91762	0
crncoa	C28H47N8O18P3S	-763.669	11.81109	-2
crnDcoa	C28H47N8O18P3S	-763.669	11.81109	-2
csn	C4H5N3O	-9.4707	3.96408	0
ctbt	C7H13NO2	-7.024	6.08355	0
ctbtcoa	C28H45N8O17P3S	-704.905	11.83692	-2
ctp	C9H12N3O14P3	-751.441	5.50203	-4
cyan	CHN	28.609	19.28607	0
cynt	CNO	-23.2789	15.03366	-1
cys_D	C3H7NO2S	-83.3366	1.867152	0
cys_L	C3H7NO2S	-83.3366	1.867152	0
cyst_L	C7H14N2O4S	-154.839	2.62002	0
cytd	C9H13N3O5	-132.803	5.4897	0
dad_2	C10H13N5O3	-5.4268	8.56017	0
dad_5	C10H13N5O3	-9.1793	8.68416	0
dadp	C10H13N5O9P2	-425.441	8.55897	-2
damp	C10H13N5O6P	-217.318	8.55147	-1
dann	C9H21N2O2	-80.8995	1.808703	1
datp	C10H13N5O12P3	-633.565	8.58147	-3
db4p	C4H8O6P	-319.89	0.946587	-1
dc2coa	C31H49N7O17P3S	-750.657	10.46331	-3
dca	C10H19O2	-73.5956	1.785066	-1
dcacoa	C31H51N7O17P3S	-771.476	10.46403	-3
dcamp	C14H15N5O11P	-408.684	8.80467	-3
dcdp	C9H13N3O10P2	-512.876	5.23926	-2
dcmp	C9H13N3O7P	-304.753	5.22699	-1
dctp	C9H13N3O13P3	-720.999	5.27592	-3
dcyt	C9H13N3O4	-92.8612	5.24124	0
dd2coa	C33H53N7O17P3S	-747.366	10.57929	-3
ddca	C12H23O2	-70.305	2.208195	-1
ddcacoa	C33H55N7O17P3S	-768.186	10.59774	-3
dgdp	C10H13N5O10P2	-475.15	7.71426	-2
dgmp	C10H13N5O7P	-267.027	7.70595	-1
dgsn	C10H13N5O4	-55.1356	7.71561	0
dgtp	C10H12N5O13P3	-673.773	7.73922	-4
dha	C3H6O3	-107.889	0.95655	0
dhap	C3H6O6P	-319.781	0.875085	-1
dhcinnm	C9H7O4	-110.739	3.68544	-1
dhf	C19H19N7O6	-109.421	8.68527	-2
dhmptp	C9H12N5O13P3	-694.275	7.53669	-4
dhna	C11H7O4	-122.811	6.29514	-1
dhnpt	C9H13N5O4	-75.6368	7.52772	0
dhor_S	C5H5N2O4	-151.488	4.19058	-1
dhpmp	C9H13N5O7P	-287.528	7.50252	-1
dhpppn	C9H9O4	-126.813	3.13287	-1
dhpt	C14H13N6O3	-2.2475	8.04309	-1
dhptd	C5H8O4	-133.815	1.463289	0
didp	C10H12N4O10P2	-480.706	7.69107	-2
dimp	C10H13N4O7P	-268.243	7.89687	0
din	C10H12N4O4	-60.6914	7.69242	0
ditp	C10H12N4O13P3	-688.829	7.71609	-3
dkmpp	C6H10O6PS	-297.212	2.497608	-1
dmbzid	C9H10N2	45.9078	4.56789	0
dmlz	C13H18N4O6	-137.733	7.62543	0
dmpp	C5H10O7P2	-438.268	1.587516	-2
dms	C2H6S	1.6998	2.128944	0
dnad	C21H24N6O15P2	-571.581	12.11073	-2
dopa	C8H12NO2	-49.9792	3.16608	1
dpcoa	C21H33N7O13P2S	-538.977	9.86907	-2
dtbt	C10H17N2O3	-115.278	4.1526	-1
dtdp	C10H14N2O11P2	-564.797	5.0739	-2
dtdp4aaddg	C18H27N3O15P2	-679.612	8.74218	-2
dtdp4addg	C16H26N3O14P2	-649.885	8.29269	-1
dtdp4d6dg	C16H22N2O15P2	-678.305	8.15874	-2
dtdp4d6dm	C16H22N2O15P2	-678.305	8.15874	-2
dtdpglu	C16H24N2O16P2	-721.189	8.37669	-2
dtdprmn	C16H24N2O15P2	-685	8.32296	-2
dtmp	C10H14N2O8P	-356.674	5.06121	-1
dttp	C10H14N2O14P3	-772.92	5.11173	-3
dudp	C9H12N2O11P2	-564.728	5.12172	-2
dump	C9H12N2O8P	-356.605	5.10918	-1
duri	C9H12N2O5	-144.713	5.12376	0
dutp	C9H12N2O14P3	-772.851	5.15922	-3
dxyl	C5H10O4	-144.029	3.33528	0
dxyl5p	C5H10O7P	-356.189	1.333122	-1
e4p	C4H8O7P	-354.643	1.284777	-1
eca2und	C103H162N6O37P2	-1081.13	31.8945	-4
eca3und	C127H198N9O52P2	-1545.39	44.352	-5
eca4colipa	C272H451N14O160P4	-5489.65	111.6384	-11
eca4und	C151H234N12O67P2	-2009.66	57.4053	-6
eig3p	C6H10N2O6P	-288.004	3.30276	-1
enlipa	C112H204N3O42P3	-1640.01	22.86729	-4
etha	C2H8NO	-44.468	0.776055	1
ethso3	C2H5O3S	-125.71	2.243241	-1
etoh	C2H6O	-43.44	1.5	0
f1p	C6H12O9P	-430.406	3.68367	-1
f6p	C6H12O9P	-430.406	3.68367	-1
fad	C27H31N9O15P2	-528.467	15.39987	-2
fadh2	C27H33N9O15P2	-536.521	14.59227	-2
fald	CH2O	-31.2	1.5	0
fc1p	C6H12O8P	-393.441	4.1436	-1
fcl_L	C6H12O5	-181.549	4.21632	0
fdp	C6H12O12P2	-642.298	3.65394	-2
fe2	Fe	-18.85	1.5	2
fe3	Fe	-1.1	1.5	3
fe3hox_un	C9H23N3O6	-134.498	6.64077	0
feoxam_un	C25H49N6O8	-222.336	12.49158	1
fgam	C8H14N2O9P	-416.711	5.16936	-1
fmn	C17H20N4O9P	-336.322	8.18055	-1
fmnh2	C17H22N4O9P	-344.376	8.70204	-1
for	CHO2	-83.9	1.5	-1
fpram	C8H15N3O8P	-379.567	6.63801	-1
fprica	C10H14N4O9P	-371.988	5.77158	-1
frdp	C15H26O7P2	-381.405	4.35951	-2
fru	C6H12O6	-218.515	3.79563	0
frulys	C12H25N2O7	-247.898	5.03448	1
frulysp	C12H25N2O10P	-459.79	4.97373	0
fruur	C6H9O7	-261.879	3.65025	-1
fuc_L	C6H12O5	-181.549	4.21632	0
fum	C4H2O4	-143.722	2.06133	-2
g1p	C6H12O9P	-429.63	4.23405	-1
g3p	C3H6O6P	-318.344	0.877194	-1
g3pc	C8H20NO6P	-254.197	6.11727	0
g3pe	C5H14NO6P	-310.895	1.809591	0
g3pg	C6H14O8P	-382.309	2.21094	-1
g3pi	C9H18O11P	-487.142	4.57305	-1
g3ps	C6H13NO8P	-390.558	1.890438	-1
g6p	C6H12O9P	-429.63	4.23405	-1
gagicolipa	C157H275N2O84P4	-3123.03	47.7486	-7
gal	C6H12O6	-217.738	4.33182	0
gal_bD	C6H12O6	-217.738	4.33182	0
gal1p	C6H12O9P	-429.63	4.23405	-1
galct_D	C6H8O8	-311.507	2.249895	-2
galctn_D	C6H11O7	-268.143	2.422695	-1
galctn_L	C6H11O7	-268.143	2.422695	-1
galt	C6H14O6	-224.779	2.679801	0
galt1p	C6H14O9P	-436.67	2.472759	-1
galur	C6H9O7	-261.103	4.21617	-1
gam	C6H14NO5	-182.623	4.24644	1
gam1p	C6H14NO8P	-394.515	4.17423	0
gam6p	C6H14NO8P	-394.515	4.17423	0
gar	C7H15N2O8P	-388.53	4.14015	0
garagund	C77H125NO22P2	-621.728	20.52591	-2
gbbtn	C7H15NO2	-27.8439	5.91264	0
gcald	C2H4O2	-70.154	0.628935	0
gdp	C10H13N5O11P2	-515.092	7.87065	-2
gdpddman	C16H21N5O15P2	-628.6	10.22472	-2
gdpfuc	C16H23N5O15P2	-635.295	10.47303	-2
gdpmann	C16H23N5O16P2	-671.484	10.5354	-2
gdpofuc	C16H21N5O15P2	-628.6	10.22472	-2
gdptp	C10H12N5O20P5	-1133.73	7.95081	-6
gfgaragund	C83H135NO27P2	-778.993	23.07744	-2
gg4abut	C9H15N2O5	-191.715	2.344971	-1
ggagicolipa	C163H285N2O89P4	-3280.78	51.7608	-7
ggbutal	C9H16N2O4	-138.922	2.336883	0
gggagicolipa	C169H295N2O94P4	-3438.53	55.8114	-7
ggptrc	C9H20N3O3	-113.236	2.577372	1
gicolipa	C151H265N2O79P4	-2965.28	43.7853	-7
glc_D	C6H12O6	-217.738	4.33182	0
glcn	C6H11O7	-268.143	2.422695	-1
glcr	C6H8O8	-311.507	2.249895	-2
glcur	C6H9O7	-261.103	4.21617	-1
glcur1p	C6H9O10P	-472.994	4.14342	-2
gln_L	C5H10N2O3	-121.6	1.722165	0
glu_D	C5H8NO4	-164.205	1.014384	-1
glu_L	C5H8NO4	-164.205	1.014384	-1
glu1sa	C5H9NO3	-111.412	0.995547	0
glu5p	C5H9NO7P	-378.878	1.116357	-1
glu5sa	C5H9NO3	-111.412	0.995547	0
glucys	C8H13N2O5S	-190.51	2.855676	-1
glx	C2HO3	-111.028	0.784296	-1
gly	C2H5NO2	-87.8321	0.661326	0
glyald	C3H6O3	-106.453	0.958479	0
glyb	C5H11NO2	-31.1345	5.88078	0
glyc	C3H8O3	-115.882	1.182813	0
glyc_R	C3H5O4	-159.246	0.880539	-1
glyc2p	C3H8O6P	-327.773	1.010166	-1
glyc3p	C3H8O6P	-327.773	1.010166	-1
glyclt	C2H3O3	-122.947	0.502221	-1
glycogen	C6H10O5	-167.2	16.98741	0
gmhep17bp	C7H14O13P2	-677.82	4.3233	-2
gmhep1p	C7H14O10P	-465.929	4.37475	-1
gmhep7p	C7H14O10P	-465.929	4.37475	-1
gmp	C10H13N5O8P	-306.969	7.86246	-1
gp4g	C20H24N10O21P4	-965.069	15.78723	-4
grdp	C10H18O7P2	-409.837	2.949786	-2
gsn	C10H13N5O5	-95.0772	7.88652	0
gthox	C20H30N6O12S2	-435.577	8.64039	-2
gthrd	C10H16N3O6S	-221.311	4.35159	-1
gtp	C10H12N5O14P3	-713.715	7.8951	-4
gtspmd	C17H36N6O5S	-159.245	6.91602	2
gua	C5H5N5O	28.2549	7.25298	0
h	H	-9.53	0	1
h2	H2	4.2065	1.5	0
h2mb4p	C5H10O8P2	-474.457	1.581021	-2
h2o	H2O	-56.687	1.5	0
h2o2	H2O2	-32.05	1.5	0
h2s	H2S	-6.66	1.5	0
hacolipa	C192H337N2O101P4	-3647	60.981	-7
halipa	C126H228N2O40P2	-1459.41	24.97038	-4
hco3	CHO3	-140.26	1.5	-1
hcys_L	C4H9NO2S	-81.6913	1.904484	0
hdca	C16H31O2	-63.7238	3.063	-1
hdcea	C16H29O2	-41.3826	2.979921	-1
hdcoa	C37H61N7O17P3S	-739.263	10.83708	-3
hdd2coa	C37H61N7O17P3S	-740.785	10.85952	-3
hhlipa	C124H222N2O51P2	-1833.09	29.36217	-4
his_L	C6H9N3O2	-46.4172	3.17931	0
hisp	C6H12N3O4P	-214.945	3.21762	0
histd	C6H13N3O	0.9469	4.3992	2
hkndd	C9H8O6	-186.177	3.17337	-2
hkntd	C9H6O6	-166.878	4.84575	-2
hlipa	C117H210N2O45P2	-1639.04	25.82232	-4
hmbil	C40H38N4O17	-478.737	17.90847	-8
hmfurn	C5H5O3	-76.7938	4.53885	-1
hmgth	C11H18N3O7S	-251.556	4.55718	-1
hom_L	C4H9NO3	-122.486	0.933747	0
hphhlipa	C131H234N2O60P3	-2239.04	33.0447	-5
hpyr	C3H3O4	-148.763	0.900711	-1
hqn	C6H6O2	-48.969	2.543181	0
hx2coa	C27H41N7O17P3S	-757.238	10.28232	-3
hxa	C6H11O2	-80.1768	0.966222	-1
hxan	C5H4N4O	22.6991	7.22829	0
hxcoa	C27H43N7O17P3S	-778.058	10.24647	-3
iasp	C4H3NO4	-172.768	4.90272	-2
ichor	C10H8O6	-170.26	3.87351	-2
icit	C6H5O7	-278.983	1.301196	-3
icolipa	C145H255N2O74P4	-2807.53	39.885	-7
idon_L	C6H11O7	-268.143	2.422695	-1
idp	C10H12N4O11P2	-520.648	7.84791	-2
ile_L	C6H13NO2	-84.7613	1.233525	0
imacp	C6H8N2O5P	-242.067	3.18477	-1
imp	C10H12N4O8P	-312.524	7.83972	-1
indole	C8H7N	53.4819	4.24557	0
inost	C6H12O6	-220.715	4.1796	0
ins	C10H12N4O5	-100.633	7.86381	0
ipdp	C5H10O7P2	-439.111	1.64928	-2
isetac	C2H5O4S	-161.899	2.279385	-1
itp	C10H12N4O14P3	-728.771	7.87242	-3
kdo	C8H13O8	-292.313	2.563068	-1
kdo2lipid4	C84H150N2O37P2	-1406.28	19.32171	-4
kdo2lipid4L	C96H172N2O38P2	-1427.28	20.70585	-4
kdo2lipid4p	C100H178N2O38P2	-1398.36	21.01779	-4
kdo8p	C8H13O11P	-506.913	3.76818	-2
kdolipid4	C76H139N2O30P2	-1171.24	16.39344	-3
kphphhlipa	C139H245N2O70P4	-2685.96	36.2193	-7
lac_D	C3H5O3	-123.057	0.69018	-1
lac_L	C3H5O3	-123.057	0.69018	-1
LalaDglu	C8H13N2O5	-195.116	2.267679	-1
LalaDgluMdap	C15H25N4O8	-301.828	4.48125	-1
LalaDgluMdapDala	C18H30N5O9	-332.739	6.27618	-1
LalaLglu	C8H13N2O5	-195.116	2.267679	-1
lald_D	C3H6O2	-70.2639	0.7872	0
lald_L	C3H6O2	-70.2639	0.7872	0
lcts	C12H22O11	-375.49	8.49903	0
leu_L	C6H13NO2	-84.7613	1.233525	0
lgt_S	C13H20N3O8S	-291.381	4.95426	-1
lipa	C110H198N2O39P2	-1444.99	22.58046	-4
lipa_cold	C114H204N2O39P2	-1416.07	22.91604	-4
lipidA	C68H128N2O23P2	-936.209	13.89867	-2
lipidAds	C68H128N2O20P	-724.318	13.93125	-1
lipidX	C34H65NO12P	-498.098	6.98355	-1
lys_L	C6H15N2O2	-84.0802	1.489923	1
lyx_L	C5H10O5	-179.442	3.85374	0
mal_D	C4H4O5	-200.965	0.838476	-2
mal_L	C4H4O5	-200.965	0.838476	-2
malcoa	C24H34N7O19P3S	-862.547	10.11075	-4
malt	C12H22O11	-375.49	8.49903	0
malt6p	C12H22O14P	-587.381	8.40879	-1
malthp	C42H72O36	-1164.25	29.77554	0
malthx	C36H62O31	-1006.5	25.51038	0
maltpt	C30H52O26	-848.745	21.24717	0
malttr	C18H32O16	-533.242	12.73458	0
maltttr	C24H42O21	-690.993	16.98741	0
man	C6H12O6	-217.738	4.33182	0
man1p	C6H12O9P	-429.63	4.23405	-1
man6p	C6H12O9P	-429.63	4.23405	-1
man6pglyc	C9H15O12P	-528.889	4.4319	-2
mana	C6H11O7	-268.143	2.422695	-1
manglyc	C9H15O9	-316.998	4.52538	-1
melib	C12H22O11	-375.49	8.49903	0
mercppyr	C3H3O3S	-107.968	1.888506	-1
met_D	C5H11NO2S	-75.7468	2.239086	0
met_L	C5H11NO2S	-75.7468	2.239086	0
methf	C20H20N7O6	-96.6139	9.01098	-1
mi1p_D	C6H12O9P	-432.606	4.04997	-1
micit	C7H7O7	-280.414	1.411347	-3
minohp	C6H12O24P6	-1492.06	4.5117	-6
mlthf	C20H21N7O6	-93.4522	8.93976	-2
mmcoa_R	C25H36N7O19P3S	-862.657	10.12986	-4
mmcoa_S	C25H36N7O19P3S	-862.657	10.12986	-4
mmet	C6H14NO2S	-66.1834	6.17076	1
mnl	C6H14O6	-224.779	2.679801	0
mnl1p	C6H14O9P	-436.67	2.472759	-1
mql8	C51H74O2	182.487	13.31457	0
mqn8	C51H72O2	208.402	12.70074	0
mso3	CH3O3S	-127.355	2.232753	-1
mthgxl	C3H4O2	-59.7804	0.940749	0
murein3p3p	C68H104N12O38	-1233.17	25.51875	-4
murein3px3p	C68H102N12O37	-1176.14	26.87898	-4
murein3px4p	C71H107N13O38	-1207.05	28.42434	-4
murein4p3p	C71H109N13O39	-1264.08	27.01296	-4
murein4p4p	C74H114N14O40	-1294.99	28.56054	-4
murein4px4p	C74H112N14O39	-1237.96	30.0153	-4
murein4px4p4p	C111H169N21O59	-1881.47	44.592	-6
murein4px4px4p	C111H167N21O58	-1824.43	46.0659	-6
murein5p3p	C74H114N14O40	-1294.99	28.56054	-4
murein5p4p	C77H119N15O41	-1325.9	30.1533	-4
murein5p5p	C80H124N16O42	-1356.81	31.7844	-4
murein5p5p5p	C120H186N24O63	-2031.23	47.9613	-6
murein5px3p	C74H112N14O39	-1237.96	30.0153	-4
murein5px4p	C77H117N15O40	-1268.87	31.6449	-4
murein5px4px4p	C114H172N22O59	-1855.35	47.6907	-6
N1aspmd	C9H23N3O	-24.6917	3.4776	2
n2o	HN2O	18.2559	4.5771	1
n8aspmd	C9H23N3O	-24.6917	3.4776	2
nac	C6H4NO2	-38.3502	3.792	-1
nad	C21H26N7O14P2	-528.976	12.27447	-1
nadh	C21H27N7O14P2	-523.788	12.08409	-2
nadp	C21H26N7O17P3	-740.867	12.24966	-2
nadph	C21H26N7O17P3	-726.179	12.05892	-4
ncam	C6H6N2O	4.2547	4.0617	0
nh4	H4N	-18.97	1.5	1
nicrnt	C11H13NO9P	-379.436	5.3523	-1
nmn	C11H15N2O8P	-336.831	5.54664	0
Nmtrp	C12H14N2O2	-16.7979	4.8756	0
no2	NO2	-8.9	1.5	-1
no3	NO3	-26.61	1.5	-1
o16a2und	C123H200N2O57P2	-1720.89	44.6871	-2
o16a3und	C157H255N3O82P2	-2505.04	64.5828	-2
o16a4colipa	C312H527N6O200P4	-6769.18	142.0143	-7
o16a4und	C191H310N4O107P2	-3289.19	84.9282	-2
o16aund	C89H145NO32P2	-936.744	26.28417	-2
o2	O2	3.9197	1.5	0
o2s	O2	6.9	1.5	-1
oaa	C4H2O5	-190.481	0.984057	-2
oc2coa	C29H45N7O17P3S	-753.947	10.36416	-3
occoa	C29H47N7O17P3S	-774.767	10.34676	-3
ocdca	C18H35O2	-60.4332	3.49257	-1
ocdcea	C18H33O2	-38.092	3.36459	-1
octa	C8H15O2	-76.8862	1.368315	-1
octdp	C40H66O7P2	-239.249	11.50536	-2
od2coa	C39H65N7O17P3S	-737.494	11.02254	-3
odecoa	C39H65N7O17P3S	-737.494	11.02254	-3
ohpb	C4H5O8P	-396.953	1.088664	-2
op4en	C5H5O3	-82.5751	2.50554	-1
orn	C5H13N2O2	-85.7255	1.375257	1
orot	C5H3N2O4	-142.467	4.50552	-1
orot5p	C10H11N2O11P	-477.69	5.43255	-2
oxam	C2H2NO3	-121.216	1.609302	-1
oxur	C3H3N2O4	-153.662	2.935515	-1
pa120	C27H52O8P	-369.777	5.42487	-1
pa140	C31H60O8P	-363.196	6.20007	-1
pa141	C31H56O8P	-318.514	6.09786	-1
pa160	C35H68O8P	-356.615	6.99672	-1
pa161	C35H64O8P	-311.932	6.79674	-1
pa180	C39H76O8P	-350.034	7.80831	-1
pa181	C39H72O8P	-305.351	7.53054	-1
pac	C8H7O2	-49.6267	2.257215	-1
pacald	C8H8O	3.1664	2.288745	0
pan4p	C11H22N2O7PS	-346.832	4.42503	-1
pant_R	C6H11O4	-159.142	1.373796	-1
pap	C10H13N5O10P2	-469.151	8.7066	-2
paps	C10H12N5O13P2S	-580.138	8.92761	-3
pdx5p	C8H11NO6P	-279.587	4.78059	-1
pe120	C29H58NO8P	-352.899	5.95299	0
pe140	C33H66NO8P	-346.317	6.72315	0
pe141	C33H62NO8P	-301.635	6.57213	0
pe160	C37H74NO8P	-339.736	7.51434	0
pe161	C37H70NO8P	-295.054	7.27704	0
pe180	C41H82NO8P	-333.155	8.32056	0
pe181	C41H78NO8P	-288.473	8.01372	0
peamn	C8H12N	28.8524	2.333463	1
pep	C3H3O6P	-315.353	1.699848	-2
pg120	C30H58O10P	-424.313	6.01119	-1
pg140	C34H66O10P	-417.731	6.77472	-1
pg141	C34H62O10P	-373.049	6.62487	-1
pg160	C38H74O10P	-411.15	7.56051	-1
pg161	C38H70O10P	-366.468	7.32471	-1
pg180	C42H82O10P	-404.569	8.36226	-1
pg181	C42H78O10P	-359.887	8.05704	-1
pgp120	C30H58O13P2	-636.204	5.99877	-2
pgp140	C34H66O13P2	-629.623	6.76371	-2
pgp141	C34H62O13P2	-584.94	6.61359	-2
pgp160	C38H74O13P2	-623.042	7.55064	-2
pgp161	C38H70O13P2	-578.359	7.31451	-2
pgp180	C42H82O13P2	-616.461	8.35335	-2
pgp181	C42H78O13P2	-571.778	8.04777	-2
phaccoa	C29H39N7O17P3S	-747.508	10.34862	-3
phe_L	C9H11NO2	-50.8107	2.360907	0
phhlipa	C124H222N2O54P3	-2044.99	29.31036	-5
phom	C4H9NO6P	-334.377	0.975738	-1
phphhlipa	C131H233N2O63P4	-2441.43	32.9943	-7
phpyr	C9H7O3	-75.4422	2.37783	-1
phthr	C4H9NO7P	-372.322	1.209567	-1
pi	HO4P	-261.974	1.5	-2
pmcoa	C28H42N7O19P3S	-855.966	10.2765	-4
pmtcoa	C37H63N7O17P3S	-761.605	10.91196	-3
pnto_R	C9H16NO5	-188.298	2.397306	-1
ppa	C3H5O2	-85.1127	0.479121	-1
ppal	C3H6O	-32.3196	0.610647	0
ppap	C3H6O5P	-299.786	0.79248	-1
ppbng	C10H13N2O4	-118.297	3.90963	-1
ppcoa	C24H37N7O17P3S	-782.994	10.12899	-3
ppgpp	C10H12N5O17P4	-925.606	7.91031	-5
pphn	C10H8O6	-187.711	3.44259	-2
ppi	H2O7P2	-480.93	1.5	-2
pppn	C9H9O2	-47.9814	2.288193	-1
pram	C5H12NO7P	-357.729	3.67638	0
pran	C12H14NO9P	-392.053	4.69203	-2
prbamp	C15H22N5O14P2	-598.345	10.2594	-1
prbatp	C15H22N5O20P4	-1014.59	10.28442	-3
prfp	C15H23N5O15P2	-649.732	12.2313	-2
prlp	C15H23N5O15P2	-649.266	10.66839	-2
pro_L	C5H8NO2	-62.749	2.717628	-1
progly	C7H11N2O3	-93.5501	3.30405	-1
prpp	C5H10O14P3	-812.859	3.73215	-3
ps120	C30H56NO10P	-433.873	6.2004	-2
ps140	C34H64NO10P	-427.292	6.94314	-2
ps141	C34H60NO10P	-382.609	6.79701	-2
ps160	C38H72NO10P	-420.71	7.7118	-2
ps161	C38H68NO10P	-376.028	7.48077	-2
ps180	C42H80NO10P	-414.129	8.4993	-2
ps181	C42H76NO10P	-369.447	8.19918	-2
psclys	C12H25N2O7	-247.898	5.03448	1
pser_L	C3H7NO6P	-336.023	0.900699	-1
ptrc	C4H14N2	-6.0624	1.396512	2
pyam5p	C8H13N2O5P	-244.472	4.77597	0
pydam	C8H13N2O2	-32.5806	4.79157	1
pydx	C8H9NO3	-59.7879	4.82073	0
pydx5p	C8H9NO6P	-271.679	4.80522	-1
pydxn	C8H11NO3	-67.6956	4.82004	0
pyr	C3H3O3	-112.574	0.861207	-1
q8	C49H74O4	146.164	13.09227	0
q8h2	C49H76O4	124.737	13.18752	0
quln	C7H3NO4	-119.494	3.93624	-2
r15bp	C5H10O11P2	-604.736	3.7149	-2
r1p	C5H10O8P	-392.844	3.7134	-1
r5p	C5H10O8P	-392.844	3.7134	-1
ragund	C69H113NO16P2	-426.521	18.14178	-2
rbflvrd	C17H22N4O6	-134.224	7.00581	0
rbl_L	C5H10O5	-180.218	3.44703	0
rdmbzi	C14H18N2O4	-77.4243	5.94042	0
rhcys	C9H17NO6S	-211.66	4.32477	0
rib_D	C5H10O5	-180.953	3.7944	0
ribflv	C17H20N4O6	-124.43	8.21763	0
rml	C6H12O5	-180.597	1.963122	0
rml1p	C6H12O8P	-392.488	1.801623	-1
rmn	C6H12O5	-181.549	4.21632	0
ru5p_D	C5H10O8P	-392.378	1.549023	-1
ru5p_L	C5H10O8P	-392.378	1.549023	-1
s	S	0	1.5	0
s7p	C7H14O10P	-464.976	2.526459	-1
sarcs	C3H7NO2	-78.9509	2.479374	0
sbt_D	C6H14O6	-224.779	2.679801	0
sbt6p	C6H14O9P	-436.67	2.472759	-1
sbzcoa	C32H40N7O20P3S	-858.346	10.61919	-4
ser_D	C3H7NO3	-124.131	0.855033	0
ser_L	C3H7NO3	-124.131	0.855033	0
seramp	C13H20N6O9P	-337.95	8.17875	1
Sfglutth	C11H16N3O7S	-253.536	4.72593	-1
skm	C7H9O5	-172.007	2.666091	-1
skm5p	C7H9O8P	-383.899	2.594115	-2
sl26da	C11H16N2O7	-269.733	2.547342	-2
sl2a6o	C11H12NO8	-294.364	2.597694	-3
so2	O2S	-71.9	1.5	0
so3	HO3S	-126.15	1.5	-1
so4	O4S	-177.97	1.5	-2
spmd	C7H22N3	5.0353	3.0687	3
ssaltpp	C16H22N4O10P2S	-462.292	7.33593	-2
stcoa	C39H67N7O17P3S	-758.314	11.09112	-3
suc6p	C12H22O14P	-588.158	7.6833	-1
sucarg	C10H17N4O5	-179.026	5.34354	-1
sucbz	C11H8O5	-160.465	2.962362	-2
succ	C4H4O4	-163.021	0.741702	-2
succoa	C25H36N7O19P3S	-860.901	10.14549	-4
sucglu	C9H10NO7	-270.194	2.286837	-3
sucgsa	C9H11NO6	-217.401	2.238432	-2
suchms	C8H12NO6	-236.203	1.75638	-1
sucorn	C9H15N2O5	-191.715	2.344971	-1
sucr	C12H22O11	-376.266	7.78194	0
sucsal	C4H5O3	-110.228	0.715725	-1
sulfac	C2H2O5S	-205.263	2.24292	-2
tag6p_D	C6H12O9P	-430.406	3.68367	-1
tagdp_D	C6H12O12P2	-642.298	3.65394	-2
tagur	C6H9O7	-261.879	3.65025	-1
tartr_L	C4H4O6	-238.909	1.239876	-2
taur	C2H7NO3S	-126.784	2.319639	0
tcynt	CNS	22.1581	17.06409	-1
td2coa	C35H57N7O17P3S	-744.075	10.71156	-3
tdcoa	C35H59N7O17P3S	-764.895	10.74726	-3
tdecoa	C35H57N7O17P3S	-742.554	10.68882	-3
thdp	C7H7NO4	-139.406	3.47916	-2
thf	C19H21N7O6	-113.942	8.73618	-2
thm	C12H17N4OS	53.9771	7.14708	1
thmmp	C12H17N4O4PS	-157.914	7.15269	0
thmpp	C12H17N4O7P2S	-366.038	7.16166	-1
thr_L	C4H9NO3	-124.241	1.145976	0
thrp	C4H9NO6P	-336.132	1.180443	-1
thym	C5H6N2O2	-61.392	4.34052	0
thymd	C10H14N2O5	-144.782	5.07594	0
tma	C3H10N	5.7928	3.14076	1
tmao	C3H10NO	8.939	5.87886	1
tre	C12H22O11	-375.49	8.49903	0
tre6p	C12H22O14P	-587.381	8.40879	-1
trp_L	C11H12N2O2	-25.6791	4.24989	0
tsul	HO3S2	-132.2	1.5	-1
ttdca	C14H27O2	-67.0144	2.63463	-1
ttdcea	C14H25O2	-45.5162	2.659749	-1
tym	C8H12NO	-10.5634	2.571234	1
tyr_L	C9H11NO3	-90.2265	2.596161	0
tyrp	C9H11NO6P	-302.118	2.61156	-1
u23ga	C43H75N3O20P2	-829.53	10.70688	-2
u3aga	C31H51N3O19P2	-811.329	9.68172	-2
u3hga	C29H50N3O18P2	-781.602	9.28776	-1
uaagmda	C95H152N8O28P2	-827.011	23.13	-4
uaccg	C20H26N3O19P2	-799.148	9.37998	-3
uacgam	C17H25N3O17P2	-755.674	9.16752	-2
uacmam	C17H25N3O17P2	-755.674	9.16752	-2
uacmamu	C17H22N3O18P2	-799.038	9.1083	-3
uagmda	C87H139N7O23P2	-674.648	20.76198	-4
uama	C23H33N4O20P2	-849.655	10.01616	-3
uamag	C28H39N5O23P2	-956.828	11.11248	-4
uamr	C20H28N3O19P2	-818.744	9.21201	-3
udcpdp	C55H90O7P2	-153.955	15.80733	-2
udcpp	C55H90O4P	54.1684	15.80328	-1
udp	C9H12N2O12P2	-604.67	5.35434	-2
udpacgal	C17H25N3O17P2	-755.674	9.16752	-2
udpg	C15H22N2O17P2	-761.062	8.81571	-2
udpgal	C15H22N2O17P2	-761.062	8.81571	-2
udpgalfur	C15H22N2O17P2	-760.575	8.46147	-2
udpglcur	C15H19N2O18P2	-804.426	8.74098	-3
udpLa4fn	C15H22N3O16P2	-715.783	8.11722	-1
udpLa4n	C14H22N3O15P2	-687.65	8.35365	-1
udpLa4o	C14H18N2O16P2	-716.07	8.22069	-2
ugmd	C35H51N7O26P2	-1063.54	12.5322	-4
ugmda	C41H61N9O28P2	-1125.36	15.50922	-4
uLa4fn	C61H100NO8P	-56.9453	16.24746	0
uLa4n	C60H100NO7P	-28.8123	16.27605	0
um4p	C38H56N8O27P2	-1094.45	13.96569	-4
ump	C9H12N2O9P	-396.546	5.34234	-1
unaga	C63H103NO12P2	-304.959	16.61172	-2
unagamu	C71H113N2O18P2	-500.687	18.40203	-3
unagamuf	C79H126N3O22P2	-616.861	21.11334	-3
ura	C4H4N2O2	-61.3229	4.39632	0
urate	C5H4N4O3	-89.7517	9.37545	0
urdglyc	C3H5N2O4	-164.146	2.795535	-1
urea	CH4N2O	-48.7	1.5	0
uri	C9H12N2O6	-184.655	5.37765	0
utp	C9H12N2O15P3	-812.793	5.39022	-3
val_L	C5H11NO2	-86.4066	1.214352	0
xan	C5H4N4O2	-27.2971	7.71948	0
xdp	C10H12N4O12P2	-570.644	8.00628	-2
xmp	C10H12N4O9P	-362.521	7.99827	-1
xtp	C10H12N4O15P3	-778.767	8.03031	-3
xtsn	C10H12N4O6	-150.629	8.02188	0
xu5p_D	C5H10O8P	-392.378	1.549023	-1
xu5p_L	C5H10O8P	-392.378	1.549023	-1
xyl_D	C5H10O5	-179.442	3.85374	0
xylu_D	C5H10O5	-180.218	3.44703	0
xylu_L	C5H10O5	-180.218	3.44703	0
